propan-2-yl 2-[[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-pyrimidin-4-yl]amino]ethanoate

Systemtic Name: propan-2-yl 2-[[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-pyrimidin-4-yl]amino]ethanoate Openeye Name: isopropyl 2-[[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-pyrimidin-4-yl]amino]acetate CAS Name: 2-[[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-4-pyrimidinyl]amino]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitropyrimidin-4-yl]amino]acetate Traditional Name: 2-[[6-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-pyrimidin-4-yl]amino]acetic acid isopropyl ester Formula: C20H22ClN5O4 MolecularWeight: 431.87278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CNC1=NC=NC(=C1[N+](=O)[O-])N2CCC(=CC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)OC(=O)CNC1=NC=NC(=C1[N+](=O)[O-])N2CCC(=CC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClN5O4/c1-13(2)30-17(27)11-22-19-18(26(28)29)20(24-12-23-19)25-9-7-15(8-10-25)14-3-5-16(21)6-4-14/h3-7,12-13H,8-11H2,1-2H3,(H,22,23,24)